SCHEMBL2769508

SCHEMBL2769508

COc1ccc(N2CCN(CCc3ccccc3)CC2)c(C#N)c1

nearest known ligand 0.61

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ADRA1D P25100 5/20 0.58
ADRA1A P35348 5/20 0.58
ADRA1B P35368 5/20 0.58
HTR1A P08908 2/20 0.58
SIGMAR1 Q99720 4/20 0.56
SLC6A4 P31645 1/20 0.50
ABCC1 P33527 1/20 0.50

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL2769304 0.84 ADRA1D (0.62) ADRA1DADRA1AADRA1BHTR1ASIGMAR1
SCHEMBL2768032 0.83 ADRA1D (0.61) ADRA1DADRA1AADRA1BHTR1ASIGMAR1
SCHEMBL2767088 0.81 HTR1A (0.51) ADRA1DADRA1AADRA1BHTR1ASIGMAR1
SCHEMBL2766536 0.80 OPRM1 (0.46) HTR1ASLC6A4
SCHEMBL2768019 0.79 SIGMAR1 (0.53) HTR1ASIGMAR1SLC6A4
SCHEMBL13150788 0.77 SIGMAR1 (0.88) SIGMAR1
SCHEMBL2766150 0.77 SIGMAR1 (0.72) ADRA1DADRA1AADRA1BHTR1ASIGMAR1
SCHEMBL2767177 0.75 MAPT (0.47) HTR1ASIGMAR1
SCHEMBL3713046 0.74 MAPT (0.59) ADRA1DADRA1AADRA1BHTR1ASLC6A4
SCHEMBL2768386 0.74 MAPT (0.49) ADRA1DADRA1AADRA1BHTR1A

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1627871-B1 CYCLIC AMINOPHENYL SULFAMATE DERIVATIVE ASKA PHARM CO LTD (JP) 2010-04-14 EP disclosed
US-7449466-B2 Cyclic aminophenyl sulfamate derivative ASKA PHARMACEUTICAL CO., LTD. (JP) 2008-11-11 US disclosed
US-20060189625-A1 Cyclic aminophenyl sulfamate derivative ASKA PHARMACEUTICAL CO., LTD. (JP) 2006-08-24 US disclosed
EP-1627871-A1 CYCLIC AMINOPHENYL SULFAMATE DERIVATIVE Teikoku Hormone Mfg. Co., Ltd. (JP) 2006-02-22 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20060189625-A1 Cyclic aminophenyl sulfamate derivative SHBG, STS, ARSA ADRA1D 2006/4885ADRA1A 2425/4885ADRA1B 1233/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.